SCHEMBL944888

SCHEMBL944888

C#CC[C@H]1COCCN1C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.39
PDK2 Q15119 1/20 0.36
PDK3 Q15120 1/20 0.36
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
GLA P06280 1/20 0.33
DPP4 P27487 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CTSS P25774 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
FKBP1A P62942 1/20 0.30
TSHR P16473 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30732668 0.85 PDK1 (0.38) PDK1PDK2PDK3CA12CA1
SCHEMBL509358 0.80 PDK1 (0.59) PDK1PDK2PDK3CA12CA1
SCHEMBL5560259 0.80 PDK1 (0.59) PDK1PDK2PDK3CA12CA1
SCHEMBL15909553 0.80 PDK1 (0.59) PDK1PDK2PDK3CA12CA1
SCHEMBL946229 0.80 PDK1 (0.35) PDK1PDK2PDK3CA12CA1
SCHEMBL16797367 0.79 PDK1 (0.41) PDK1PDK2PDK3CA12CA1
SCHEMBL19056428 0.79 PDK1 (0.41) PDK1PDK2PDK3CA12CA1
SCHEMBL17791708 0.79 PDK1 (0.41) PDK1PDK2PDK3CA12CA1
SCHEMBL570641 0.79 PDK1 (0.41) PDK1PDK2PDK3CA12CA1
SCHEMBL19056488 0.79 PDK1 (0.41) PDK1PDK2PDK3CA12CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8710054-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2014-04-29 US disclosed
EP-2170906-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2013-04-03 EP disclosed
US-20130079330-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2013-03-28 US disclosed
US-8338592-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA, S.A. (BE) 2012-12-25 US disclosed
US-8242116-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-08-14 US disclosed
US-8168634-B2 Thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-05-01 US disclosed
EP-2035436-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2011-05-25 EP disclosed
US-20110003785-A1 Fused Thiazole Derivatives As Kinase Inhibitors UCB PHARMA, S.A. (BE) 2011-01-06 US disclosed
US-20100298310-A1 Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-11-25 US disclosed
US-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-06-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110003785-A1 Fused Thiazole Derivatives As Kinase Inhibitors PI4KA, PDPK1, MAP4K2 PDK1 95/4885PDK2 104/4885PDK3 183/4885
US-20130079330-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, MAP4K2 PDK1 95/4885PDK2 104/4885PDK3 183/4885
US-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, PIK3CA PDK1 75/4885PDK2 97/4885PDK3 156/4885
US-20100298310-A1 Thiazole Derivatives as Kinase Inhibitors TEC, BTK, PI4KA PDK1 144/4885PDK2 179/4885PDK3 360/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.